ChemicalBook--->CAS DataBase List--->122-19-0

122-19-0

122-19-0 Structure

122-19-0 Structure
IdentificationMore
[Name]

Stearyldimethylbenzylammonium chloride
[CAS]

122-19-0
[Synonyms]

AMMONYX(TM) 4B
BENZYLDIMETHYL-N-OCTADECYL AMMONIUM CHLORIDE
BENZYLDIMETHYLOCTADECYLAMMONIUM CHLORIDE
BENZYLDIMETHYLSTEARYLAMMONIUM CHLORIDE
BENZYLOCTADECYLDIMETHYLAMMONIUM CHLORIDE
CARSOQUAT SDQ 85
OCTADECYLDIMETHYL BENZYL AMMONIUM CHLORIDE
SKC
STEARALKONIUM CHLORIDE
STEARYLDIMETHYLBENZYL AMMONIUM CHLORIDE
2b
2b(oniumcompound)
alkyl*dimethylbenzylammoniumchloride*(100%c18)
alkyldimethylbenzylammoniumchloride(100%c18)
ammonyx4
ammonyx4002
ammonyx485
ammonyx490
ammonyxcaspecial
arquaddm18b-90
[EINECS(EC#)]

204-527-9
[Molecular Formula]

C27H50ClN
[MDL Number]

MFCD00011776
[Molecular Weight]

424.15
[MOL File]

122-19-0.mol
Chemical PropertiesBack Directory
[Appearance]

Paste
[Melting point ]

54-56°C
[density ]

0.98
[vapor pressure ]

0Pa at 25℃
[storage temp. ]

Inert atmosphere,Room Temperature
[solubility ]

Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly)
[form ]

Solid
[color ]

White to Off-White
[Odor]

at 100.00?%. bland
[Water Solubility ]

4000 G/L (20 ºC)
[Usage]

Carsoquat(R) SDQ-25 is used in hair care formulations, as a hair conditioner and cream rinse.
[Henry's Law Constant]

2.3×105 mol/(m3Pa) at 25℃, HSDB (2015)
[Cosmetics Ingredients Functions]

ANTISTATIC
SURFACTANT - CLEANSING
PRESERVATIVE
[InChI]

InChI=1S/C27H50N.ClH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-25-28(2,3)26-27-23-20-19-21-24-27;/h19-21,23-24H,4-18,22,25-26H2,1-3H3;1H/q+1;/p-1
[InChIKey]

SFVFIFLLYFPGHH-UHFFFAOYSA-M
[SMILES]

C1(=CC=CC=C1)C[N+](C)(C)CCCCCCCCCCCCCCCCCC.[Cl-]
[LogP]

3.89 at 20℃
[Uses]

stearalkonium chloride is an anti-static that can also be used as a surfactant and/or a preservative depending on formulatory requirements.
[CAS DataBase Reference]

122-19-0(CAS DataBase Reference)
[EPA Substance Registry System]

122-19-0(EPA Substance)
Safety DataBack Directory
[Symbol(GHS) ]

Corrosion (GHS05)Exclamation Mark (GHS07)
GHS05,GHS07
[Signal word ]

Danger
[Hazard statements ]

H302-H318
[Precautionary statements ]

P264-P270-P280-P301+P312+P330-P305+P351+P338+P310-P501
[Hazard Codes ]

C,N
[Risk Statements ]

R22:Harmful if swallowed.
R38:Irritating to the skin.
R41:Risk of serious damage to eyes.
R50:Very Toxic to aquatic organisms.
R34:Causes burns.
R21/22:Harmful in contact with skin and if swallowed .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S61:Avoid release to the environment. Refer to special instructions safety data sheet .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
[WGK Germany ]

WGK 2
[RTECS ]

BO7000000
[TSCA ]

TSCA listed
[REACH Registrations]

Active
[HS Code ]

29239000
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Aquatic Acute 1
Aquatic Chronic 1
Eye Dam. 1
[Safety Profile]

Poison by intraperitoneal route. Moderately toxic by ingestion. A human skin irritant and severe experimental eye irritant. When heated to decomposition it emits very toxic fumes of NOx, NH3, and Cl-.
[Hazardous Substances Data]

122-19-0(Hazardous Substances Data)
[Toxicity]

LD50 oral in rat: 1250mg/kg
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Benzyl chloride-->Octadecanamine-->1-Chlorooctadecane-->1-Octadecanol-->N,N-Dimethyloctadecylamine
Hazard InformationBack Directory
[General Description]

White solid or thick liquid with a mild odor.
[Reactivity Profile]

Acidic organic salt solutions contain moderate concentrations of hydrogen ions and have pH's of less than 7.0. They react as acids to neutralize bases.
[Air & Water Reactions]

Insoluble in water.
[Health Hazard]

Ingestion causes gastrointestinal disturbances. Contact with chemical irritates eyes and skin and may damage eyes.
[Fire Hazard]

Special Hazards of Combustion Products: Toxic oxides of nitrogen and hydrochloric acid fumes may form in fires.
[Chemical Properties]

Paste
[Preparation]

Synthesis of benzyldimethylstearylammonium chloride: put 450kg of dimethyl octadecylamine into the reaction kettle, heat to 80~85℃, and slowly add 180kg of benzyl chloride under stirring in 1.5~2h. Keep warm at 80~90℃ during the drop addition. After the dosing is completed, increase the temperature to 100~105℃, hold the reaction for several hours and take samples to measure the pH value. When the pH value of 1% aqueous solution reaches 6~6.5, the reaction is completed. Cool down to 60℃ and discharge to get benzyldimethylstearylammonium chloride.
[Flammability and Explosibility]

Notclassified
[storage]

Store at -20°C
[Purification Methods]

Crystallise the salt from acetone, EtOAc or EtOAc/ Et2O. [Sumiki et al. J Agric Chem Soc Jpn 26 325 1952, Chem Abstr 3505 1953, Beilstein 12 III 2212, 12 IV 2168.]
Spectrum DetailBack Directory
[Spectrum Detail]

Stearyldimethylbenzylammonium chloride(122-19-0)MS
Stearyldimethylbenzylammonium chloride(122-19-0)1HNMR
Stearyldimethylbenzylammonium chloride(122-19-0)13CNMR
Stearyldimethylbenzylammonium chloride(122-19-0)IR1
Stearyldimethylbenzylammonium chloride(122-19-0)IR2
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

122-19-0(sigmaaldrich)
[TCI AMERICA]

Benzyldimethylstearylammonium Chloride  Hydrate,>98.0%(T)(122-19-0)
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